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Substance Name: Docosanol [USAN]
RN: 661-19-8
UNII: 9G1OE216XY
InChIKey: NOPFSRXAKWQILS-UHFFFAOYSA-N
Classification Codes
- Anti-Infective Agents
- Antiviral Agents
- Antiviral used in the Treatment of Herpes Simplex Labialis
Molecular Formula
- C22-H46-O
Molecular Weight
- 326.604
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 1-Docosanol
- Behenyl alcohol
- Docosanol
- Docosanol [USAN]
Synonyms
- 1-Docosanol
- 4-01-00-01906 (Beilstein Handbook Reference)
- Abreva
- AI3-36489
- Behenic alcohol
- Behenyl alcohol
- BRN 1770470
- CCRIS 8943
- Docosanol
- Docosyl alcohol
- EC 211-546-6
- EINECS 211-546-6
- HSDB 5739
- IK 2
- Lanette 22
- Lidavol
- n-Docosanol
- NAA 422
- Nacol 22-97
- NSC 8407
- Stenol 1822
- Stenol 1822A
- Tadenan
- UNII-9G1OE216XY
Systematic Names
- 1-Docosanol
- Docosan-1-ol
Superlist Names
- 1-Docosanol
- Behenyl alcohol
Registry Numbers
CAS Registry Number
- 661-19-8
FDA UNII
- 9G1OE216XY
System Generated Number
- 0000661198
Structure Descriptors
InChI
InChI=1S/C22H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3InChIKey
NOPFSRXAKWQILS-UHFFFAOYSA-NSmiles
CCCCCCCCCCCCCCCCCCCCCCOToxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | > 800mg/kg (800mg/kg) | Drugs of the Future. Vol. 17, Pg. 879, 1992. | |
mouse | LD50 | intravenous | > 800mg/kg (800mg/kg) | Drugs of the Future. Vol. 17, Pg. 879, 1992. | |
mouse | LD50 | subcutaneous | > 800mg/kg (800mg/kg) | Drugs of the Future. Vol. 17, Pg. 879, 1992. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | 72.5 | deg C | EXP | |
log P (octanol-water) | 9.680 | (none) | EST | |
Atmospheric OH Rate Constant | 3.23E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.